Found 2 results

Search term: MF = 'C_{14}H_{10}BrF_{3}O_{4}'
ChemSpider 2D Image | 3-(3-Bromopropoxy)-4-(trifluoroacetyl)-1H-isochromen-1-one | C14H10BrF3O4

3-(3-Bromopropoxy)-4-(trifluoroacetyl)-1H-isochromen-1-one

  • Molecular FormulaC14H10BrF3O4
  • Average mass379.126 Da
  • Monoisotopic mass377.971436 Da
  • ChemSpider ID34963864

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1H-2-Benzopyran-1-one, 3-(3-bromopropoxy)-4-(2,2,2-trifluoroacetyl)- [ACD/Index Name]
3-(3-Bromopropoxy)-4-(2,2,2-trifluoroacétyl)-1H-isochromén-1-one [French] [ACD/IUPAC Name]
3-(3-Bromopropoxy)-4-(trifluoroacetyl)-1H-isochromen-1-one [ACD/IUPAC Name]
3-(3-Brompropoxy)-4-(trifluoracetyl)-1H-isochromen-1-on [German] [ACD/IUPAC Name]
1H-2-BENZOPYRAN-1-ONE, 3-(3-BROMOPROPOXY)-4-(TRIFLUOROACETYL)-
3-(3-Bromopropoxy)-4-(trifluoroacetyl)-1H-2-benzopyran-1-one
913837-01-1 [RN]
Isocoumarin, 10c

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.6±0.1 g/cm3
Boiling Point: 420.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.4±3.0 kJ/mol
Flash Point: 208.0±28.7 °C
Index of Refraction: 1.546
Molar Refractivity: 73.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.50
ACD/LogD (pH 5.5): 3.98
ACD/BCF (pH 5.5): 627.64
ACD/KOC (pH 5.5): 3501.07
ACD/LogD (pH 7.4): 3.98
ACD/BCF (pH 7.4): 627.64
ACD/KOC (pH 7.4): 3501.07
Polar Surface Area: 53 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 46.0±5.0 dyne/cm
Molar Volume: 230.6±5.0 cm3

Click to predict properties on the Chemicalize site


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